4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde
TL;DR: 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde (CAS 255377-95-8) is a chemical compound with molecular formula C11H8Cl2OS and molecular weight 257.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde
Also Known As: 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde, 4,6-Dichloro-2-Methyl-2H-1-Benzothiine-3-Carbaldehyde, trans-2,4-Difluorocinnamic acid, 4,6-dichloro-2-methyl-2H-1-benzothiine-3-carboxaldehyde, 4,6-Dichloro-2-methyl-2H-1-benzothiopyran-3-carbaldehyde
| Molecular Formula | C11H8Cl2OS |
|---|---|
| Molecular Weight | 257.97 g/mol |
| LogP | 3.983 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.9673 |
| Heavy Atoms | 15 |
| Complexity | 453.90118 |
Chemical Identifiers
| CAS Number | 255377-95-8 |
|---|---|
| SMILES | CC1C(=C(C2=C(S1)C=CC(=C2)Cl)Cl)C=O |
Product Overview
4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde (CAS 255377-95-8), with molecular formula C11H8Cl2OS and molecular weight 257.97 g/mol. IUPAC: 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde.
Chemical Property Profile of 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde
Property Insights of 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde
The XLogP value of 3.983 indicates that 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde?
The CAS number of 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde is 255377-95-8.
What is the molecular formula of 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde?
The molecular formula of 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde is C11H8Cl2OS.
What is the molecular weight of 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde?
The molecular weight of 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde is 257.97 g/mol.
Where can I buy 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde?
You can request a quote for 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4,6-dichloro-2-methyl-2H-thiochromene-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.